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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:69339 - carpesiolin
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ChEBI Name
carpesiolin
ChEBI ID
CHEBI:69339
Definition
A sesquiterpene lactonethat is 2,3-dihydroaromaticin substituted by an α-hydroxy group at position 6. It has been isolated from the aerial parts of
Inula hupehensis
.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C15H20O4
Net Charge
0
Average Mass
264.31690
Monoisotopic Mass
264.13616
InChI
InChI=1S/C15H20O4/c1-
7-
6-
10-
12(8(2)
14(18)
19-
10)
13(17)
15(3)
9(7)
4-
5-
11(15)
16/h7,9-
10,12-
13,17H,2,4-
6H2,1,3H3/t7-
,9+,10+,12-
,13+,15+/m1/s1
InChIKey
IOUNDPHKKPZPKB-GSNHZRAGSA-N
SMILES
C[C@@H]1C[C@@H]2OC(=O)C(=C)[C@H]2[C@H](O)[C@@]2(C)[C@H]1CCC2=O
Metabolite of Species
Details
Inula hupehensis
(IPNI:225932-1)
Found in aerial part
(BTO:0001658)
. 95% aqueous EtOH extract of dried and powdered aerial parts See:
PubMed
Roles Classification
Biological Role
(s):
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application
(s):
anti-inflammatory agent
Any compound that has anti-inflammatory effects.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
carpesiolin (
CHEBI:69339
)
has role
anti-inflammatory agent (
CHEBI:67079
)
carpesiolin (
CHEBI:69339
)
has role
metabolite (
CHEBI:25212
)
carpesiolin (
CHEBI:69339
)
has role
plant metabolite (
CHEBI:76924
)
carpesiolin (
CHEBI:69339
)
is a
γ-lactone (
CHEBI:37581
)
carpesiolin (
CHEBI:69339
)
is a
cyclic ketone (
CHEBI:3992
)
carpesiolin (
CHEBI:69339
)
is a
organic heterotricyclic compound (
CHEBI:26979
)
carpesiolin (
CHEBI:69339
)
is a
secondary alcohol (
CHEBI:35681
)
carpesiolin (
CHEBI:69339
)
is a
sesquiterpene lactone (
CHEBI:37667
)
IUPAC Name
(3a
S
,4
S
,4a
R
,7a
S
,8
R
,9a
S
)-
4-
hydroxy-
4a,8-
dimethyl-
3-
methylidenedecahydroazuleno[6,5-
b
]furan-
2,5-
dione
Synonyms
Sources
4-oxo-6-hydroxypseudoguai-11(13)-en-8,12-olide
ChEBI
6α-hydroxy-2,3-dihydroaromaticin
ChEBI
Registry Number
Type
Source
6571345
Reaxys Registry Number
Reaxys
Citation
Type
Source
21894898
PubMed citation
Europe PMC
Last Modified
18 December 2013